Prostaglandin Impurity 8

CAT: 1299-RM-P151468-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-P151468-01Size:10 mg

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CAS Number

71155-05-0

Synonyms

(1R,5S) -bicyclo[3.2.0]hept-2-en-6-one

Molecular Formula

C7H8O

Molecular Weight

108.14

Target Alternative Name

Prostaglandin

Product Name Synonym

(1R,5S) -bicyclo[3.2.0]hept-2-en-6-one

Chemical Information

(1R,5S)-Bicyclo[3.2.0]hept-2-en-6-one

CAS Number	71155-05-0
PubChem CID	7472015
IUPAC Name	(1R,5S)-bicyclo[3.2.0]hept-2-en-6-one
Molecular Formula	C7H8O
Molecular Weight	108.14
XLogP	0.7
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	8
Formal Charge	0
Complexity	158

SMILES

C1C=C[C@@H]2[C@H]1C(=O)C2

InChI

InChI=1S/C7H8O/c8-7-4-5-2-1-3-6(5)7/h1-2,5-6H,3-4H2/t5-,6-/m0/s1

InChIKey

LNLLHUHPGPKRBM-WDSKDSINSA-N

Chemical Structure

2D Structure

CAS: 71155-05-0

CID: 7472015

Formula: C7H8O

MW: 108.14

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	108.14
XLogP3	0.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	108.057514874
Monoisotopic Mass	108.057514874
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	158
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes